2-[2,2,2-trifluoro-1-(trifluoromethyl)-1-[5,5-dimethyl-1,3,2-dioxaphosphorinan-2-yloxy]ethyl]-4-methyl-1-(5,5-dimethyl-1,3,2-dioxaphosphorinan-2-yloxy)benzene | 381732-47-4

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: 2-[2,2,2-trifluoro-1-(trifluoromethyl)-1-[5,5-dimethyl-1,3,2-dioxaphosphorinan-2-yloxy]ethyl]-4-methyl-1-(5,5-dimethyl-1,3,2-dioxaphosphorinan-2-yloxy)benzene
• 英文别名: 2-[2,2,2-Trifluoro-1-(trifluoromethyl)-1-[5,5-di-methyl-1,3,2-dioxaphosphorinan-2-yloxy]ethyl]-4-methyl-1-(5,5-dimethyl-1,3,2-dioxaphosphorinan-2-yloxy)benzene；2-[2-[2-[(5,5-dimethyl-1,3,2-dioxaphosphinan-2-yl)oxy]-1,1,1,3,3,3-hexafluoropropan-2-yl]-4-methylphenoxy]-5,5-dimethyl-1,3,2-dioxaphosphinane
• CAS: 381732-47-4
• 化学式: C₂₀H₂₆F₆O₆P₂
• 分子量: 538.361
• InChiKey: CGYZEACGOUHFIB-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5.9
• 重原子数：
  34
• 可旋转键数：
  5
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.7
• 拓扑面积：
  55.4
• 氢给体数：
  0
• 氢受体数：
  12

反应信息

• 作为反应物：
  描述：

  2-[2,2,2-trifluoro-1-(trifluoromethyl)-1-[5,5-dimethyl-1,3,2-dioxaphosphorinan-2-yloxy]ethyl]-4-methyl-1-(5,5-dimethyl-1,3,2-dioxaphosphorinan-2-yloxy)benzene 在 sulfur 作用下， 以 1,4-二氧六环 为溶剂， 反应 7.0h， 以24%的产率得到2-[2,2,2-trifluoro-1-(trifluoromethyl)-1-[5,5-dimethyl-1,3,2-dioxaphosphorinan-2-yloxy]ethyl]-4-methyl-1-(5,5-dimethyl-2-thioxo-1,3,2λ⁵-dioxaphosphorinan-2-yloxy)benzene
  参考文献：
  名称：

  摘要：

  2-Polyfluoroalkoxy-1,3,2-dioxaphosphorinanes and related phosphocyclic compounds were prepared by alcoholysis of 2-amino-1,3,2-dioxaphosphorinanes with polyfluorinated alcohols. Principal chemical properties of the products were studied. For the first time copper complexes of fluorine-containing normal phosphites were prepared. A difference in the ligation of copper with fluorinated and nonfluorinated phosphites was shown.

  DOI：

  10.1023/a:1012362630312
• 作为产物：
  描述：

  2-diethylamino-5,5-dimethyl-1,3,2-dioxaphosphorinane 、 2-[2,2,2-trifluoro-1-(trifluoromethyl)-1-hydroxyethyl]-4-methylphenol 生成 2-[2,2,2-trifluoro-1-(trifluoromethyl)-1-[5,5-dimethyl-1,3,2-dioxaphosphorinan-2-yloxy]ethyl]-4-methyl-1-(5,5-dimethyl-1,3,2-dioxaphosphorinan-2-yloxy)benzene
  参考文献：
  名称：

  摘要：

  2-Polyfluoroalkoxy-1,3,2-dioxaphosphorinanes and related phosphocyclic compounds were prepared by alcoholysis of 2-amino-1,3,2-dioxaphosphorinanes with polyfluorinated alcohols. Principal chemical properties of the products were studied. For the first time copper complexes of fluorine-containing normal phosphites were prepared. A difference in the ligation of copper with fluorinated and nonfluorinated phosphites was shown.

  DOI：

  10.1023/a:1012362630312